8005-9341 Screening compound: [(ethoxycarbonyl)(2-methoxy-2-oxoethyl)amino]methyl[2-(2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undec-1-yl)ethyl]phosphinic acid

8005-9341 Screening compound: [(ethoxycarbonyl)(2-methoxy-2-oxoethyl)amino]methyl[2-(2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undec-1-yl)ethyl]phosphinic acid
8005-9341 Screening compound: [(ethoxycarbonyl)(2-methoxy-2-oxoethyl)amino]methyl[2-(2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undec-1-yl)ethyl]phosphinic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 8005-9341
[(ethoxycarbonyl)(2-methoxy-2-oxoethyl)amino]methyl[2-(2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undec-1-yl)ethyl]phosphinic acid

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

8005-9341

Molecular Formula

C15H29N2O9PSi (C15 H29 N2 O9 PSi)

Compound Name

[(ethoxycarbonyl)(2-methoxy-2-oxoethyl)amino]methyl[2-(2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undec-1-yl)ethyl]phosphinic acid

IUPAC name

{[(ethoxycarbonyl)(2-methoxy-2-oxoethyl)amino]methyl}(2-{289-trioxa-5-aza-1-silabicyclo[3.3.3]undecan-1-yl}ethyl)phosphinic acid

SMILES

CCOC(N(CC(OC)=O)CP(CC[Si]1(OCC2)OCCN2CCO1)(O)=O)=O

InChI

InChI=1S/C15H29N2O9PSi/c1-3-23-15(19)17(12-14(18)22-2)13-27(20,21)10-11-28-24-7-4-16(5-8-25-28)6-9-26-28/h3-13H2,1-2H3,(H,20,21)

InChI Key

DSKCACIWLIXMGJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00822920

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

440.46

Hydrogen Bond Acceptors Count

13.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

-1.986

Distribution Coefficient, logD

-7.496

Water Solubility, LogSw

0.18

Polar Surface Area

104.087

Acid Dissociation Constant (pKa)

1.89

Base Dissociation Constant (pKb)

6.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

86.67

References: we are preparing a list of scientific research reports with 8005-9341 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8005-9341?
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What is the minimum amount of 8005-9341 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8005-9341
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8005-9341
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 8005-9341 available by request